2-(4-ethylpiperazine-1,4-diium-1-yl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]ethanamide

Systemtic Name: 2-(4-ethylpiperazine-1,4-diium-1-yl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-(4-ethylpiperazine-1,4-diium-1-yl)-N-[5-(4-nitrophenyl)sulfonylthiazol-2-yl]acetamide CAS Name: 2-(4-ethyl-1-piperazine-1,4-diiumyl)-N-[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]acetamide IUPAC Name: 2-(4-ethylpiperazine-1,4-diium-1-yl)-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(4-ethylpiperazine-1,4-diium-1-yl)-N-(5-nosylthiazol-2-yl)acetamide Formula: C17H23N5O5S2+2 MolecularWeight: 441.52502

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CC(=O)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CC(=O)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O5S2/c1-2-20-7-9-21(10-8-20)12-15(23)19-17-18-11-16(28-17)29(26,27)14-5-3-13(4-6-14)22(24)25/h3-6,11H,2,7-10,12H2,1H3,(H,18,19,23)/p+2